3-[(4-methylphenyl)methylsulfanyl]-5-(2-methylsulfanylphenyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(4-methylphenyl)methylsulfanyl]-5-(2-methylsulfanylphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-methylsulfanylphenyl)-4-phenyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(4-methylphenyl)methylthio]-5-[2-(methylthio)phenyl]-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(4-methylphenyl)methylsulfanyl]-5-(2-methylsulfanylphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[(4-methylbenzyl)thio]-5-[2-(methylthio)phenyl]-4-phenyl-1,2,4-triazole Formula: C23H21N3S2 MolecularWeight: 403.56294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4SC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4SC

InChI

InChI=1S/C23H21N3S2/c1-17-12-14-18(15-13-17)16-28-23-25-24-22(20-10-6-7-11-21(20)27-2)26(23)19-8-4-3-5-9-19/h3-15H,16H2,1-2H3